Ac3TbPt3
Alexandria ALEXAlex-ID: agm005902809 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_864_spg14
Ac4Pt3 Ac2Tb3Pt4 Ac3Pt2
2023-08-06 21:42:12.250029
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005902809).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm005902809
data_agm005902809
_cell_length_a 7.65054
_cell_length_b 8.75895
_cell_length_c 13.47119
_cell_angle_alpha 90.28287
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 902.70347
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Ac1 Ac 0.84354 0.88292 0.83241 1.00000
Ac2 Ac 0.65646 0.88292 0.33241 1.00000
Ac3 Ac 0.31675 0.62862 0.67140 1.00000
Ac4 Ac 0.80621 0.61934 0.57269 1.00000
Ac5 Ac 0.18325 0.62862 0.17140 1.00000
Ac6 Ac 0.69379 0.61934 0.07269 1.00000
Ac7 Ac 0.30621 0.38066 0.92731 1.00000
Ac8 Ac 0.81675 0.37138 0.82860 1.00000
Ac9 Ac 0.19379 0.38066 0.42731 1.00000
Ac10 Ac 0.68325 0.37138 0.32860 1.00000
Ac11 Ac 0.34354 0.11708 0.66759 1.00000
Ac12 Ac 0.15646 0.11708 0.16759 1.00000
Tb1 Tb 0.34560 0.85962 0.93409 1.00000
Tb2 Tb 0.15440 0.85962 0.43409 1.00000
Tb3 Tb 0.84560 0.14038 0.56591 1.00000
Tb4 Tb 0.65440 0.14038 0.06591 1.00000
Pt1 Pt 0.04749 0.88341 0.63518 1.00000
Pt2 Pt 0.45251 0.88341 0.13518 1.00000
Pt3 Pt 0.04873 0.65187 0.95402 1.00000
Pt4 Pt 0.45127 0.65187 0.45402 1.00000
Pt5 Pt 0.56508 0.63293 0.85220 1.00000
Pt6 Pt 0.93492 0.63293 0.35220 1.00000
Pt7 Pt 0.06508 0.36707 0.64780 1.00000
Pt8 Pt 0.43492 0.36707 0.14780 1.00000
Pt9 Pt 0.54873 0.34813 0.54598 1.00000
Pt10 Pt 0.95127 0.34813 0.04598 1.00000
Pt11 Pt 0.54749 0.11659 0.86482 1.00000
Pt12 Pt 0.95251 0.11659 0.36482 1.00000
